3-(4-hydroxyphenyl)-2-[(3-octadecoxy-2-oxidanyl-propyl)amino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[(3-octadecoxy-2-oxidanyl-propyl)amino]propanoic acid Openeye Name: 2-[(2-hydroxy-3-octadecoxy-propyl)amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[(2-hydroxy-3-octadecoxypropyl)amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-[(2-hydroxy-3-octadecoxypropyl)amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 3-(4-hydroxyphenyl)-2-[(2-hydroxy-3-stearyloxy-propyl)amino]propionic acid Formula: C30H53NO5 MolecularWeight: 507.74552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CNC(CC1=CC=C(C=C1)O)C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CNC(CC1=CC=C(C=C1)O)C(=O)O)O

InChI

InChI=1S/C30H53NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-36-25-28(33)24-31-29(30(34)35)23-26-18-20-27(32)21-19-26/h18-21,28-29,31-33H,2-17,22-25H2,1H3,(H,34,35)